[3-ethanoyl-1,2-bis(oxidanyl)-4-oxidanylidene-pentan-3-yl] octadecanoate

Systemtic Name: [3-ethanoyl-1,2-bis(oxidanyl)-4-oxidanylidene-pentan-3-yl] octadecanoate Openeye Name: (1,1-diacetyl-2,3-dihydroxy-propyl) octadecanoate CAS Name: octadecanoic acid (3-acetyl-1,2-dihydroxy-4-oxopentan-3-yl) ester IUPAC Name: (3-acetyl-1,2-dihydroxy-4-oxopentan-3-yl) octadecanoate Traditional Name: stearic acid (1,1-diacetyl-2,3-dihydroxy-propyl) ester Formula: C25H46O6 MolecularWeight: 442.62914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(C(CO)O)(C(=O)C)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(C(CO)O)(C(=O)C)C(=O)C

InChI

InChI=1S/C25H46O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24(30)31-25(21(2)27,22(3)28)23(29)20-26/h23,26,29H,4-20H2,1-3H3